3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine

Name: 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₇H₈N₂ — CID 91174119

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine

SMILESC1=CC2N=CCC2N=C1

InChIInChI=1S/C7H8N2/c1-2-6-7(8-4-1)3-5-9-6/h1-2,4-7H,3H2

InChIKeyCVBHVCHRNHLULU-UHFFFAOYSA-N

MW120.15 g/mol

LogP0.84

Rot. Bonds

About 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine

3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine (PubChem CID 91174119) has the molecular formula C₇H₈N₂ and a molecular weight of 120.15 g/mol. Its IUPAC name is 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name	3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine
PubChem CID	91174119
Molecular Formula	C₇H₈N₂
Molecular Weight	120.15 g/mol
Exact Mass	120.07
IUPAC Name	3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine
SMILES	C1=CC2N=CCC2N=C1
InChI	InChI=1S/C7H8N2/c1-2-6-7(8-4-1)3-5-9-6/h1-2,4-7H,3H2
InChIKey	CVBHVCHRNHLULU-UHFFFAOYSA-N
XLogP	0.84
TPSA	24.72 Å²
H-Bond Donors
H-Bond Acceptors	2
Rotatable Bonds
Heavy Atoms	9
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	120.15
LogP ≤ 5	0.84
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine?

The IUPAC name of 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine (CID 91174119) is 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine.

What is the SMILES notation for 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine?

The canonical SMILES for 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine is C1=CC2N=CCC2N=C1.

What is the InChIKey of 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine?

The InChIKey is CVBHVCHRNHLULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2/c1-2-6-7(8-4-1)3-5-9-6/h1-2,4-7H,3H2.

What are the key properties of 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine?

3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine has a molecular weight of 120.15 g/mol, XLogP of 0.84, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 91174119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 91174119 — identifiers, structure, computed properties (public domain)

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